Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | USP1 | O94782 | 1/20 | 0.33 |
| ▸ | WDR48 | Q8TAF3 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9857802 | 0.87 | PTGS2 (0.44) | PTGS2PTGS1 | |
| SCHEMBL9857503 | 0.84 | PTGS2 (0.43) | PTGS2PTGS1 | |
| SCHEMBL9520263 | 0.84 | HMGCR (0.39) | PTGS2PTGS1MEN1RAB9AKMT2A | |
| SCHEMBL9857916 | 0.80 | AKR1C2 (0.39) | PTGS2PTGS1AKR1C3AKR1C2MEN1 | |
| SCHEMBL9857482 | 0.78 | PTGS2 (0.36) | PTGS2 | |
| SCHEMBL9857094 | 0.74 | PTGS2 (0.41) | PTGS2PTGS1MEN1RAB9AKMT2A | |
| SCHEMBL5171500 | 0.71 | PTGS2 (0.48) | PTGS2PTGS1ERN1 | |
| SCHEMBL5762155 | 0.71 | ACHE (0.48) | PTGS2PTGS1MEN1KMT2A | |
| SCHEMBL9857622 | 0.70 | AKR1C2 (0.42) | PTGS2PTGS1AKR1C3AKR1C2 | |
| SCHEMBL20232768 | 0.70 | KAT6A (0.40) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5072023-A | Reacting lactone with ester anion to form cyclohexenone ester; oxidizing or dehydrogenating the intermediate | E. R. SQUIBB & SONS, INC. (US) | 1991-12-10 | — | — | US | disclosed |
| EP-0442495-A1 | Process for preparing highly substituted phenyls | E.R. SQUIBB & SONS, INC. (US) | 1991-08-21 | — | — | EP | disclosed |